4-tert-butyl-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
Chemical Structure Depiction of
4-tert-butyl-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
4-tert-butyl-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide
Compound characteristics
| Compound ID: | D433-0082 |
| Compound Name: | 4-tert-butyl-N-[(5,7-dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methyl]-N-phenylbenzamide |
| Molecular Weight: | 413.52 |
| Molecular Formula: | C25 H27 N5 O |
| Smiles: | Cc1cc(C)n2c(n1)nc(CN(C(c1ccc(cc1)C(C)(C)C)=O)c1ccccc1)n2 |
| Stereo: | ACHIRAL |
| logP: | 4.587 |
| logD: | 4.587 |
| logSw: | -4.3758 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 47.171 |
| InChI Key: | JQNYFIOGLDNULH-UHFFFAOYSA-N |